SCHEMBL3277359

SCHEMBL3277359

NC(Cc1ccccc1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.60
ACP1 P24666 1/20 0.54
PTPN7 P35236 1/20 0.54
PTPN12 Q05209 1/20 0.54
PTPN13 Q12923 1/20 0.54
SSU72 Q9NP77 1/20 0.54
P2RX1 P51575 3/20 0.54
MYC P01106 1/20 0.51
MAX P61244 1/20 0.51
TP53 P04637 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
BACE1 P56817 2/20 0.49
AKT1 P31749 1/20 0.49
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
ALPI P09923 1/20 0.47
PKM P14618 1/20 0.47
PTGS1 P23219 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3277354 1.00 TACR1 (0.60) TACR1ACP1PTPN7PTPN12PTPN13
SCHEMBL21880132 0.90 MEN1 (0.59) POLBMAPT
SCHEMBL21880131 0.90 MEN1 (0.59) POLBMAPT
SCHEMBL21880198 0.88 MAPT (0.65) TP53POLBMAPTBACE1AKT1
SCHEMBL21880197 0.88 MAPT (0.65) TP53POLBMAPTBACE1AKT1
SCHEMBL11306381 0.86 TACR1 (0.63) TACR1ACP1PTPN7PTPN12PTPN13
SCHEMBL30454484 0.82 BACE1 (0.52) BACE1AKT1ALPIPKMPTGS1
SCHEMBL5019067 0.82 ALDH1A1 (0.53) TP53POLBMAPTPKMLMNA
SCHEMBL2312372 0.81 BACE1 (0.63) BACE1AKT1ALPIPKMPTGS1
SCHEMBL2312361 0.81 BACE1 (0.63) BACE1AKT1ALPIPKMPTGS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIV OF TEXAS SY (US) 2023-05-04 US disclosed
WO-2021151104-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-07-29 WO disclosed
US-7700655-B2 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-04-20 US disclosed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185110-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20060122243-A1 Antiallergic INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-06-08 US disclosed
US-20060111409-A1 Medicament for treatment of diabetes INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-05-25 US disclosed
US-20060100257-A1 Inhibitors against the activation of ap-1 and nfat INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-05-11 US disclosed
US-20060019958-A1 Immunity-related protein kinase inhibitors INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-01-26 US disclosed
EP-1514544-A1 ANTIALLERGIC Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-16 EP disclosed
EP-1512396-A1 INHIBITORS AGAINST THE ACTIVATION OF AP-1 AND NFAT Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-09 EP disclosed
EP-1510207-A1 THERAPEUTIC DRUG FOR DIABETES Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-02 EP disclosed
EP-1510210-A1 IMMUNITY-RELATED PROTEIN KINASE INHIBITORS Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060019958-A1 Immunity-related protein kinase inhibitors MAP3K1, MAP3K7, MAP3K8 TACR1 4852/4885ACP1 360/4885PTPN7 701/4885
US-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING EIF2AK2, SARS1, ACE TACR1 4370/4885ACP1 3867/4885PTPN7 3665/4885
US-20060111409-A1 Medicament for treatment of diabetes XDH, SLC5A1, SLC5A2 TACR1 1746/4885ACP1 1790/4885PTPN7 1788/4885
US-20080090779-A1 ANTIALLERGIC AGENTS NAT1, EPX, HRH2 TACR1 1398/4885ACP1 2814/4885PTPN7 3657/4885
US-20060122243-A1 Antiallergic EPX, NAT1, HNMT TACR1 1407/4885ACP1 2881/4885PTPN7 3557/4885
US-20060100257-A1 Inhibitors against the activation of ap-1 and nfat NFATC1, AP1G1, ATF1 TACR1 2677/4885ACP1 147/4885PTPN7 430/4885
US-20070185110-A1 Antiallergic agents NAT1, EPX, AHR TACR1 1540/4885ACP1 2683/4885PTPN7 3258/4885
US-20070185059-A1 Antiallergic agents NAT1, EPX, AHR TACR1 1524/4885ACP1 2680/4885PTPN7 3381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.